methyl 2-[2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(1-p-phenetylbenzimidazol-2-yl)thio]acetyl]amino]acetic acid methyl ester Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)NCC(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)NCC(=O)OC

InChI

InChI=1S/C20H21N3O4S/c1-3-27-15-10-8-14(9-11-15)23-17-7-5-4-6-16(17)22-20(23)28-13-18(24)21-12-19(25)26-2/h4-11H,3,12-13H2,1-2H3,(H,21,24)